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trans-tert-butyl 4-(diethoxyphosphoryl)-2-thioxo-5-o-tolylimidazolidine-1-carboxylate
SpectraBase Compound ID BX81wcfpqMl
InChI InChI=1S/C19H29N2O5PS/c1-7-24-27(23,25-8-2)16-15(14-12-10-9-11-13(14)3)21(17(28)20-16)18(22)26-19(4,5)6/h9-12,15-16H,7-8H2,1-6H3,(H,20,28)/t15-,16-/m1/s1
InChIKey RAYDPZIXQVUAIO-HZPDHXFCSA-N
Mol Weight 428.48 g/mol
Molecular Formula C19H29N2O5PS
Exact Mass 428.15348 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rbTVwpCm2Q
Name trans-tert-butyl 4-(diethoxyphosphoryl)-2-thioxo-5-o-tolylimidazolidine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29N2O5PS
InChI InChI=1S/C19H29N2O5PS/c1-7-24-27(23,25-8-2)16-15(14-12-10-9-11-13(14)3)21(17(28)20-16)18(22)26-19(4,5)6/h9-12,15-16H,7-8H2,1-6H3,(H,20,28)/t15-,16-/m1/s1
InChIKey RAYDPZIXQVUAIO-HZPDHXFCSA-N
Molecular Weight 428.484 g/mol
SMILES N1C(N([C@@]([C@]1(P(OCC)(OCC)=O)[H])(c1c(cccc1)C)[H])C(OC(C)(C)C)=O)=S
SPLASH splash10-0006-0900000000-42774e0b1365c586cafb
Source of Spectrum RCM-24-2325-trans_4
Synonyms tert-Butyl (4R,5R)-4-(diethoxyphosphoryl)-2-thioxo-5-(o-tolyl)imidazolidine-1-carboxylate
Wiley ID 1814649